Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 1/20 | 0.36 |
| ▸ | SMYD2 | Q9NRG4 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14183589 | 0.86 | SMN1; SMN2 (0.37) | ALKSMYD2CYP3A4HTTSMN1; SMN2 | |
| SCHEMBL18180529 | 0.83 | HDAC3 (0.39) | SMYD2CYP3A4HTTSMN1; SMN2ABL1 | |
| SCHEMBL542769 | 0.78 | SMYD2 (0.34) | ALKSMYD2CYP3A4HTTSMN1; SMN2 | |
| SCHEMBL3638318 | 0.77 | SMYD2 (0.36) | ALKSMYD2CYP3A4HTTSMN1; SMN2 | |
| SCHEMBL8882196 | 0.77 | CES1 (0.38) | HTTALDH1A1KMT2AMEN1 | |
| SCHEMBL31092036 | 0.76 | SMYD2 (0.37) | ALKSMYD2CYP3A4HTTSMN1; SMN2 | |
| SCHEMBL1733172 | 0.75 | SMYD2 (0.33) | ALKSMYD2CYP3A4HTTSMN1; SMN2 | |
| SCHEMBL7781357 | 0.75 | POLB (0.39) | CYP3A4HTTSMN1; SMN2ABL1ALDH1A1 | |
| SCHEMBL17093480 | 0.75 | SMYD2 (0.34) | ALKSMYD2CYP3A4HTTSMN1; SMN2 | |
| SCHEMBL34473624 | 0.73 | SMYD2 (0.34) | ALKSMYD2CYP3A4HTTSMN1; SMN2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7335753-B2 | Bifunctional heterocyclic compounds and methods of making and using same | RIB-X PHARMACEUTICALS, INC. (US) | 2008-02-26 | — | — | US | disclosed |